(phenylmethyl) (2E)-6-chloranyl-2-[[(2R)-5-oxidanylideneoxolan-2-yl]methylidene]hexanoate

Systemtic Name: (phenylmethyl) (2E)-6-chloranyl-2-[[(2R)-5-oxidanylideneoxolan-2-yl]methylidene]hexanoate Openeye Name: benzyl (2E)-6-chloro-2-[[(2R)-5-oxotetrahydrofuran-2-yl]methylene]hexanoate CAS Name: (2E)-6-chloro-2-[[(2R)-5-oxo-2-oxolanyl]methylidene]hexanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2E)-6-chloro-2-[[(2R)-5-oxooxolan-2-yl]methylidene]hexanoate Traditional Name: (E)-2-(4-chlorobutyl)-3-[(2R)-5-ketotetrahydrofuran-2-yl]acrylic acid benzyl ester Formula: C18H21ClO4 MolecularWeight: 336.80994

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)OC1C=C(CCCCCl)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CC(=O)O[C@H]1/C=C(\CCCCCl)/C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H21ClO4/c19-11-5-4-8-15(12-16-9-10-17(20)23-16)18(21)22-13-14-6-2-1-3-7-14/h1-3,6-7,12,16H,4-5,8-11,13H2/b15-12+/t16-/m1/s1